N-[(5-bromanylthiophen-3-yl)methyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[(5-bromanylthiophen-3-yl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[(5-bromo-3-thienyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[(5-bromo-3-thiophenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[(5-bromothiophen-3-yl)methyl]-4-methyl-3-nitroaniline Traditional Name: (5-bromo-3-thienyl)methyl-(4-methyl-3-nitro-phenyl)amine Formula: C12H11BrN2O2S MolecularWeight: 327.19694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CSC(=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CSC(=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H11BrN2O2S/c1-8-2-3-10(5-11(8)15(16)17)14-6-9-4-12(13)18-7-9/h2-5,7,14H,6H2,1H3